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Emerging quantum computing algorithms for quantum chemistry

arXiv
Authors: Mario Motta, Julia Rice

Year

2021

Paper ID

61773

Status

Preprint

Abstract Read

~2 min

Abstract Words

101

Citations

N/A

Abstract

Digital quantum computers provide a computational framework for solving the Schrödinger equation for a variety of many-particle systems. Quantum computing algorithms for the quantum simulation of these systems have recently witnessed remarkable growth, notwithstanding the limitations of existing quantum hardware, especially as a tool for electronic structure computations in molecules. In this review, we provide a self-contained introduction to emerging algorithms for the simulation of Hamiltonian dynamics and eigenstates, with emphasis on their applications to the electronic structure in molecular systems. Theoretical foundations and implementation details of the method are discussed, and their strengths, limitations, and recent advances are presented.

Why This Paper Matters

  • This paper contributes to the Quantum Simulation research area in the Quantum Articles archive.
  • It adds a 2021 reference point for readers tracking recent quantum research.
  • Digital quantum computers provide a computational framework for solving the Schrödinger equation for a variety of many-particle systems.

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